SCHEMBL31346261

SCHEMBL31346261

Cc1cc(Nc2ccccc2)n2c(n1)nc1ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.60
KDM4E B2RXH2 4/20 0.60
ALDH1A1 P00352 3/20 0.60
MAPT P10636 4/20 0.52
HPGD P15428 2/20 0.52
MEN1 O00255 2/20 0.52
TSHR P16473 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
HTT P42858 1/20 0.49
MAPK1 P28482 2/20 0.46
ATM Q13315 2/20 0.45
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALK Q9UM73 1/20 0.44
ABCB1 P08183 1/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29449194 0.80 KDM4E (0.57) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL18033083 0.75 KDM4E (0.56) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL12395170 0.74 KDM4E (0.55) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL12395173 0.74 KDM4E (0.55) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL18033166 0.72 KDM4E (0.52) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL29683890 0.71 MAPT (0.83) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL18118625 0.70 MEN1 (0.79) GAAALDH1A1MEN1TSHRKMT2A
SCHEMBL15180305 0.68 KDM4E (0.57) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL31673809 0.67 LMNA (0.73) GAAKDM4EMAPTMEN1TSHR
SCHEMBL15101603 0.67 LMNA (0.73) GAAKDM4EMAPTMEN1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114423763-B Regioselective synthesis of imidazo [1,2-a ] pyrimidines 豪夫迈·罗氏有限公司 2025-01-21 CN disclosed